Author:
Guha Rajarshi,Medina-Franco José L
Publisher
Springer Science and Business Media LLC
Subject
Library and Information Sciences,Computer Graphics and Computer-Aided Design,Physical and Theoretical Chemistry,Computer Science Applications
Reference34 articles.
1. Maggiora GM: On outliers and activity cliffs-why QSAR often disappoints. J Chem Inf Model. 2006, 46 (4): 1535-10.1021/ci060117s.
2. Shanmugasundaram V, Maggiora GM: Characterizing Property and Activity Landscapes using an Information-Theoretic Approach. CINF-032. 222nd ACS National Meeting, Chicago, IL, United States: August 26–30; Chicago, IL, United States. 2001, Washington, D. C: American Chemical Society
3. Medina-Franco JL: Scanning structure–activity relationships with structure–activity similarity and related maps: from consensus activity cliffs to selectivity switches. J Chem Inf Model. 2012, 52 (10): 2485-2493. 10.1021/ci300362x.
4. Guha R, VanDrie JH: Structure-activity landscape index: identifying and quantifying activity cliffs. J Chem Inf Model. 2008, 48 (3): 646-658. 10.1021/ci7004093.
5. Peltason L, Bajorath J: SAR index: quantifying the nature of structure-activity relationships. J Med Chem. 2007, 50 (23): 5571-5578. 10.1021/jm0705713.
Cited by
9 articles.
订阅此论文施引文献
订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献